3,3-bis[(4-nitrophenyl)sulfanyl]-2-benzofuran-1-one

Systemtic Name: 3,3-bis[(4-nitrophenyl)sulfanyl]-2-benzofuran-1-one Openeye Name: 3,3-bis[(4-nitrophenyl)sulfanyl]isobenzofuran-1-one CAS Name: 3,3-bis[(4-nitrophenyl)thio]-1-isobenzofuranone IUPAC Name: 3,3-bis[(4-nitrophenyl)sulfanyl]-2-benzofuran-1-one Traditional Name: 3,3-bis[(4-nitrophenyl)thio]phthalide Formula: C20H12N2O6S2 MolecularWeight: 440.44908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC2(SC3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC2(SC3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H12N2O6S2/c23-19-17-3-1-2-4-18(17)20(28-19,29-15-9-5-13(6-10-15)21(24)25)30-16-11-7-14(8-12-16)22(26)27/h1-12H